9-butyl-7-decoxy-1-methyl-pyrido[3,4-b]indole hydrochloride

Systemtic Name: 9-butyl-7-decoxy-1-methyl-pyrido[3,4-b]indole hydrochloride Openeye Name: 9-butyl-7-decoxy-1-methyl-pyrido[3,4-b]indole hydrochloride CAS Name: 9-butyl-7-decoxy-1-methylpyrido[3,4-b]indole hydrochloride IUPAC Name: 9-butyl-7-decoxy-1-methylpyrido[3,4-b]indole hydrochloride Traditional Name: 9-butyl-7-decoxy-1-methyl-$b-carboline hydrochloride Formula: C26H39ClN2O MolecularWeight: 431.05366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC2=C(C=C1)C3=C(N2CCCC)C(=NC=C3)C.Cl

Isomeric SMILES

CCCCCCCCCCOC1=CC2=C(C=C1)C3=C(N2CCCC)C(=NC=C3)C.Cl

InChI

InChI=1S/C26H38N2O.ClH/c1-4-6-8-9-10-11-12-13-19-29-22-14-15-23-24-16-17-27-21(3)26(24)28(18-7-5-2)25(23)20-22;/h14-17,20H,4-13,18-19H2,1-3H3;1H